U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry MIXED
Molecular Formula C60H106O40
Molecular Weight 1467.4596
Optical Activity UNSPECIFIED
Defined Stereocenters 34 / 40
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HYDROXYPROPYL BETADEX

SMILES

[H][C@]12C[C@@H](O)[C@]([H])(O[C@@H]1COCC(C)O)O[C@]3([H])[C@@H](CO)O[C@]([H])(O[C@]4([H])[C@@H](CO)O[C@]([H])(O[C@]5([H])[C@@H](CO)O[C@]([H])(O[C@]6([H])[C@@H](COCC(C)O)O[C@]([H])(O[C@]7([H])[C@@H](CO)O[C@]([H])(O[C@]8([H])[C@@H](COCC(C)O)O[C@]([H])(O2)[C@H](O)[C@H]8O)[C@H](O)[C@H]7OCC(C)O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](OCC(C)O)[C@H]4O)[C@H](OCC(C)O)[C@H]3O

InChI

InChIKey=FCVINZIHPISTIY-YBOQSWHISA-N
InChI=1S/C60H106O40/c1-21(65)12-81-18-33-28-7-27(71)54(92-33)95-46-30(9-62)90-60(52(42(46)78)85-16-25(5)69)99-47-31(10-63)91-59(53(43(47)79)86-17-26(6)70)98-45-29(8-61)88-56(40(76)36(45)72)96-48-35(20-83-14-23(3)67)94-57(41(77)38(48)74)100-50-32(11-64)89-58(44(80)51(50)84-15-24(4)68)97-49-34(19-82-13-22(2)66)93-55(87-28)39(75)37(49)73/h21-80H,7-20H2,1-6H3/t21?,22?,23?,24?,25?,26?,27-,28+,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42+,43+,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55+,56-,57-,58-,59-,60-/m1/s1

HIDE SMILES / InChI

Molecular Formula C60H106O40
Molecular Weight 1467.4596
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 34 / 40
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:51:32 UTC 2023
Edited
by admin
on Fri Dec 15 15:51:32 UTC 2023
Record UNII
1I96OHX6EK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HYDROXYPROPYLBETADEX (0.58-0.68 MS)
Preferred Name English
HYDROXYPROPYL BETADEX
NF   USP-RS  
Common Name English
HYDROXYPROPYL BETADEX [USP-RS]
Common Name English
HYDROXYPROPYLBETADEX [MART.]
Common Name English
HYDROXYL-PROPYL-BETA-CYCLODEXTRIN
Common Name English
HYDROXYPROPYL BCD
Common Name English
HYDROXYPROPYL-BCYCLODEXTRIN [II]
Common Name English
2-hydroxypropyl-beta-cyclodextrin [WHO-DD]
Common Name English
HYDROXYPROPYL BETADEX COMPONENT OF TRAPPSOL CYCLO
Common Name English
HYDROXYPROPYL BETACYCLODEXTRIN
Common Name English
TRAPPSOL CYCLO COMPONENT HYDROXYPROPYL BETADEX
Common Name English
HYDROXYPROPYL .BETA.-CYCLODEXTRIN
Common Name English
2-HYDROXYPROPYL-BETA-CYCLODEXTRIN
WHO-DD  
Common Name English
HYDROXYPROPYL BETADEX [NF]
Common Name English
BETA-CYCLODEXTRIN, 2-HYDROXYPROPYL ETHER (0.58-0.68 MS)
Common Name English
HYDROXYPROPYL-BCYCLODEXTRIN
II  
Common Name English
MEDIUM MOLECULAR SUBSTITION HYDROXYPROPYL-BETACYCLODEXTRIN
Common Name English
HPBCD
Common Name English
Classification Tree Code System Code
EU-Orphan Drug EU/3/11/895
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
Code System Code Type Description
ECHA (EC/EINECS)
603-269-8
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
PRIMARY
RS_ITEM_NUM
1329709
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
PRIMARY
DAILYMED
1I96OHX6EK
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
PRIMARY
RXCUI
1363608
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
PRIMARY RxNorm
PUBCHEM
138059664
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
PRIMARY
DRUG BANK
DB15379
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
PRIMARY
SMS_ID
100000127098
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
PRIMARY
CAS
165677-31-6
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
ALTERNATIVE
EVMPD
SUB32181
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
PRIMARY
FDA UNII
1I96OHX6EK
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
PRIMARY
CAS
128446-35-5
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
GENERIC (FAMILY)
CAS
94035-02-6
Created by admin on Fri Dec 15 15:51:32 UTC 2023 , Edited by admin on Fri Dec 15 15:51:32 UTC 2023
SUPERSEDED
Related Record Type Details
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
DEGREE OF SUBSTITUTION CHEMICAL